Name: 8-ethynyl-1,4-dioxaspiro[4.5]decan-8-ol
SMILES:
C#CC1(O)CCC2(CC1)OCCO2Molecular Processing
Molecular formula
C10H14O3
Molecular weight
182.22
Exact mass
182.0943
XLogP
0.67
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
46.89
Supplementary Information
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